N-(3,4,5-tridodecyloxyphenyl)maleimide | 173219-13-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯啉
• 英文名称: N-(3,4,5-tridodecyloxyphenyl)maleimide
• 英文别名: 1-{3,4,5-tris(dodecyloxy)phenyl}maleimide；1-(3,4,5-Tridodecoxyphenyl)pyrrole-2,5-dione；1-(3,4,5-tridodecoxyphenyl)pyrrole-2,5-dione
• CAS: 173219-13-1
• 化学式: C₄₆H₇₉NO₅
• 分子量: 726.137
• InChiKey: IVBMBUIGHICILL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  17.7
• 重原子数：
  52
• 可旋转键数：
  37
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.78
• 拓扑面积：
  65.1
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  N-(3,4,5-tridodecyloxyphenyl)maleimide 、 2,5-二溴噻吩1,1-二氧化物 以 N,N-二甲基甲酰胺 为溶剂， 反应 18.0h， 以22%的产率得到3,6-dibromo-N-(3,4,5-tridodecyloxyphenyl)phthalimide
  参考文献：
  名称：

  Toward poly(aminophthalimide), structures of dimers and trimers

  摘要：

  Poly(aminophthalimide) (PAP) dimers and trimers have been synthesized by palladium-catalyzed cross-coupling reactions of 3-aminophthalimides with 3-chloro- and 3,6-dichlorophthalimide, respectively. When Pd(OAc)(2), XPhos (2-dicyclohexylphosphino-2',4',6'- triisopropylbiphenyl), and K3PO4 are used, the C-N bond-forming reactions proceed quantitatively. The structures of those oligomers are examined by experimental and theoretical techniques including NMR, IR, single-crystal X-ray diffraction, and DFT calculations. The strong preference for cisoid structure of the diphthalimidylamine unit bearing a bifurcate hydrogen bonding is disclosed. Therefore, the aminophthalimide backbone is a highly promising candidate for the construction of a dynamically ordered helical structure. (C) 2007 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2007.04.002
• 作为产物：
  描述：

  3,4,5-tris(dodec-1-yloxy)aniline 在 sodium acetate 、 乙酸酐 作用下， 以 N,N-二甲基甲酰胺 、 甲苯 为溶剂， 反应 6.0h， 生成 N-(3,4,5-tridodecyloxyphenyl)maleimide
  参考文献：
  名称：

  Toward poly(aminophthalimide), structures of dimers and trimers

  摘要：

  Poly(aminophthalimide) (PAP) dimers and trimers have been synthesized by palladium-catalyzed cross-coupling reactions of 3-aminophthalimides with 3-chloro- and 3,6-dichlorophthalimide, respectively. When Pd(OAc)(2), XPhos (2-dicyclohexylphosphino-2',4',6'- triisopropylbiphenyl), and K3PO4 are used, the C-N bond-forming reactions proceed quantitatively. The structures of those oligomers are examined by experimental and theoretical techniques including NMR, IR, single-crystal X-ray diffraction, and DFT calculations. The strong preference for cisoid structure of the diphthalimidylamine unit bearing a bifurcate hydrogen bonding is disclosed. Therefore, the aminophthalimide backbone is a highly promising candidate for the construction of a dynamically ordered helical structure. (C) 2007 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2007.04.002

文献信息

• Template-Assisted Benzannulation Route to Pentacene and Tetracene Derivatives and its Application to Construct Amphiphilic Acenes That Self-Assemble into Helical Wires
  作者：Bikash Pal、Chun-Hsiung Chang、Cian-Jhe Zeng、Chih-Hsiu Lin

  DOI：10.1002/chem.201703084

  日期：2017.12.11

  on template-assisted multiple benzannulation emerges. This efficient and versatile approach enables the synthesis of terminal-ring-substituted pentacene and tetracene derivatives with considerable structure diversity. With this protocol, the authors also revealed an amphiphilic pentacene derivative that self-assembles to form helical nanowires.

  当并苯结构被视为双链多烯时，出现了基于模板辅助的多个苯并环的合成策略。这种有效且通用的方法能够合成具有显着结构多样性的端环取代的并五苯和并四苯衍生物。利用该方案，作者还揭示了一种自组装形成螺旋纳米线的两亲并五苯衍生物。